LMST01031386
  LIPID_MAPS_STRUCTURE_DATABASE

 40 43  0  0  0  0  0  0  0  0999 V2000
    8.2421   -6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2954   -7.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2954   -8.2298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2421   -8.7765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1889   -8.2298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1357   -8.7765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0827   -8.2298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0827   -7.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1357   -6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1889   -7.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1357   -5.4967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0827   -4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0293   -5.4967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0293   -6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9231   -6.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9231   -5.4967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9762   -4.9500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0293   -4.6493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1889   -6.3712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9762   -4.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0859   -3.8370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7338   -3.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4911   -4.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2485   -3.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0058   -4.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7634   -3.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5893   -4.5961    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9762   -3.1430    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6182   -8.6208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1889   -8.9561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0827   -6.2073    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1151   -7.5094    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.0293   -7.4382    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7899   -4.9964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1357   -9.7774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6309   -7.2976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9495   -8.7302    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2486   -2.6382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6294   -4.1383    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0058   -5.0755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
  1 10  1  0  0  0  0
  5 10  1  0  0  0  0
  9 10  1  0  0  0  0
  8 14  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  1  0  0  0
 10 19  1  1  0  0  0
 20 21  1  6  0  0  0
 17 27  1  6  0  0  0
 20 28  1  1  0  0  0
  5 30  1  6  0  0  0
  8 31  1  1  0  0  0
  9 32  1  6  0  0  0
 14 33  1  6  0  0  0
 16 34  1  1     0  0
  6 35  1  1     0  0
 15 36  1  6     0  0
  7 37  1  6     0  0
  3 29  1  1  0  0  0
 24 38  1  1     0  0
 26 39  1  0     0  0
 25 40  1  1     0  0
M  END
> <LM_ID>
LMST01031386

> <COMMON_NAME>
Maculasteroid D

> <SYSTEMATIC_NAME>
24-methyl-Cholestane-3beta,5alpha,6beta,7alpha,15alpha,16beta,26-heptol

> <FORMULA>
C28H50O7

> <MASS>
498.36

> <CATEGORY>
Sterol Lipids [ST]

> <MAIN_CLASS>
Sterols [ST01]

> <SUB_CLASS>
Ergosterols and C24-methyl derivatives [ST0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Campestane-3beta,5alpha,6beta,7alpha,15alpha,16beta,26-heptol; 3beta,5alpha,6beta,7alpha,15alpha,16beta,26-heptahydroxycampestanol

> <INCHI_KEY>
SXONZVQHRNZOPE-RPPQWMKSSA-N

> <INCHI>
InChI=1S/C28H50O7/c1-14(16(3)13-29)6-7-15(2)20-23(32)24(33)21-19-18(9-10-26(20,21)4)27(5)11-8-17(30)12-28(27,35)25(34)22(19)31/h14-25,29-35H,6-13H2,1-5H3/t14-,15-,16-,17+,18+,19-,20+,21-,22+,23-,24-,25-,26-,27-,28+/m1/s1

> <SMILES>
C1[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])([C@]([H])(C)CC[C@@H](C)[C@H](C)CO)[C@@H](O)[C@H](O)[C@@]4([H])[C@]3([H])[C@H](O)[C@@H](O)[C@@]2(O)C[C@@H](O)C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
ST 28:0;O7

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178334285

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
60584

> <CITATION>
41794352

$$$$